# generated using pymatgen
data_As2Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.09372031
_cell_length_b   6.09813098
_cell_length_c   6.19400718
_cell_angle_alpha   90.00000000
_cell_angle_beta   112.83313667
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   As2Ir
_chemical_formula_sum   'As8 Ir4'
_cell_volume   212.13472096
_cell_formula_units_Z   4
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  As  As0  1  0.15441666  0.87400115  0.87411563  1.0
  As  As1  1  0.84558334  0.37400115  0.62588437  1.0
  As  As2  1  0.84558334  0.12599885  0.12588437  1.0
  As  As3  1  0.15441666  0.62599885  0.37411563  1.0
  As  As4  1  0.33827041  0.37113815  0.18387911  1.0
  As  As5  1  0.66172959  0.87113815  0.31612089  1.0
  As  As6  1  0.66172959  0.62886185  0.81612089  1.0
  As  As7  1  0.33827041  0.12886185  0.68387911  1.0
  Ir  Ir8  1  0.27221259  0.49955255  0.79151832  1.0
  Ir  Ir9  1  0.72778741  -0.00044745  0.70848168  1.0
  Ir  Ir10  1  0.72778741  0.50044745  0.20848168  1.0
  Ir  Ir11  1  0.27221259  0.00044745  0.29151832  1.0